pyridyl-4-ammonium nitrate | 871347-90-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: pyridyl-4-ammonium nitrate
• 英文别名: nitric acid;pyridin-4-amine
• CAS: 871347-90-9
• 化学式: C₅H₆N₂*HNO₃
• 分子量: 157.129
• InChiKey: CIYGOBBBJVCQDH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.32
• 重原子数：
  11.0
• 可旋转键数：
  0.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  102.28
• 氢给体数：
  2.0
• 氢受体数：
  4.0

反应信息

• 作为产物：
  描述：

  4-氨基吡啶 在 硝酸 作用下， 以70%的产率得到pyridyl-4-ammonium nitrate
  参考文献：
  名称：

  Preparation, characterization and thermolysis of nitrate salt of aminopyridines, Part-85

  摘要：

  Recent work has described the preparation and characterization of nitrate salts of 2, 3- and 4-aminopyridines. 3- and 4-Aminopyridine salts were characterized by X-ray crystallography. Thermal and ignition characteristics of these salts were studied by TG, simultaneous TG-DSC and ignition delay measurements. The kinetics of thermal decomposition was evaluated by model fitting and isoconversional methods using isothermal TG data. When subjected to high temperature, these salts undergo exothermic self propagative decomposition reactions leading to ignition. The proton transfer process seems to be the primary step in the thermolysis of these salts. The energy of activation for decomposition (E-alpha) and ignition (E*) were found to be linearly related with pK(a) of the corresponding amine. (C) 2012 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molstruc.2011.12.037